BCJ9M8
-OEChem-04012118292D
59 61 0 1 0 0 0 0 0999 V2000
6.3108 -1.7990 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
9.7749 -1.7990 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
11.5070 2.2010 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
10.1409 2.5670 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
11.5070 1.2010 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.0819 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
10.2749 0.3349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1768 -0.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
11.5070 -0.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.2749 3.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9089 -0.2990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.2749 2.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.2361 2.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.2361 3.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.4961 1.1729 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.7749 1.2010 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
8.9089 0.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2749 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6409 1.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7749 -0.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0429 -0.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6409 -0.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7749 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0429 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7749 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1871 2.1240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1768 -2.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9089 -2.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1871 3.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4271 1.8452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1768 -3.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9089 -3.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0429 -3.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5135 2.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5316 0.8507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7045 1.6642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7226 0.2629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8090 0.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6968 1.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2983 0.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8575 2.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1672 2.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3764 -1.2740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1734 -1.2740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9649 1.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8949 0.3349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0395 0.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2424 0.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3787 4.3317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5070 -1.4190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6399 -3.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4458 -3.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0429 -4.4190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0813 0.7122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1026 1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4487 2.8686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0980 0.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1381 1.9164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7874 -0.3537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 27 1 0 0 0 0
2 28 1 0 0 0 0
3 19 1 0 0 0 0
4 19 1 0 0 0 0
5 19 1 0 0 0 0
6 38 1 0 0 0 0
7 16 1 0 0 0 0
7 46 1 0 0 0 0
8 21 2 0 0 0 0
9 22 1 0 0 0 0
9 50 1 0 0 0 0
10 23 2 0 0 0 0
11 17 1 0 0 0 0
11 20 1 0 0 0 0
11 21 1 0 0 0 0
12 18 1 0 0 0 0
12 23 1 0 0 0 0
12 45 1 0 0 0 0
13 14 1 0 0 0 0
13 26 1 0 0 0 0
13 30 1 0 0 0 0
14 29 2 0 0 0 0
15 26 1 0 0 0 0
15 54 1 0 0 0 0
15 55 1 0 0 0 0
16 17 1 0 0 0 0
16 18 1 0 0 0 0
16 19 1 0 0 0 0
17 39 1 0 0 0 0
17 40 1 0 0 0 0
18 41 1 0 0 0 0
18 42 1 0 0 0 0
20 22 1 0 0 0 0
20 43 1 0 0 0 0
20 44 1 0 0 0 0
21 24 1 0 0 0 0
22 47 1 0 0 0 0
22 48 1 0 0 0 0
23 25 1 0 0 0 0
24 27 2 0 0 0 0
24 28 1 0 0 0 0
25 26 2 0 0 0 0
25 29 1 0 0 0 0
27 31 1 0 0 0 0
28 32 2 0 0 0 0
29 49 1 0 0 0 0
30 34 2 0 0 0 0
30 35 1 0 0 0 0
31 33 2 0 0 0 0
31 51 1 0 0 0 0
32 33 1 0 0 0 0
32 52 1 0 0 0 0
33 53 1 0 0 0 0
34 36 1 0 0 0 0
34 56 1 0 0 0 0
35 37 2 0 0 0 0
35 57 1 0 0 0 0
36 38 2 0 0 0 0
36 58 1 0 0 0 0
37 38 1 0 0 0 0
37 59 1 0 0 0 0
M END
$$$$